2-decyl-4-(4-imidazol-1-ylphenoxy)isoindole-1,3-dione

Systemtic Name: 2-decyl-4-(4-imidazol-1-ylphenoxy)isoindole-1,3-dione Openeye Name: 2-decyl-4-(4-imidazol-1-ylphenoxy)isoindoline-1,3-dione CAS Name: 2-decyl-4-[4-(1-imidazolyl)phenoxy]isoindole-1,3-dione IUPAC Name: 2-decyl-4-(4-imidazol-1-ylphenoxy)isoindole-1,3-dione Traditional Name: 2-decyl-4-(4-imidazol-1-ylphenoxy)isoindoline-1,3-quinone Formula: C27H31N3O3 MolecularWeight: 445.55334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN1C(=O)C2=C(C1=O)C(=CC=C2)OC3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

CCCCCCCCCCN1C(=O)C2=C(C1=O)C(=CC=C2)OC3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C27H31N3O3/c1-2-3-4-5-6-7-8-9-18-30-26(31)23-11-10-12-24(25(23)27(30)32)33-22-15-13-21(14-16-22)29-19-17-28-20-29/h10-17,19-20H,2-9,18H2,1H3